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Home Other Building Blocks 2-(4-methylpiperidin-4-yl)-1,3-benzothiazole hydrochloride

2-(4-methylpiperidin-4-yl)-1,3-benzothiazole hydrochloride

CAS No.:
1803604-60-5
Catalog Number:
AG01BA8N
Molecular Formula:
C13H17ClN2S
Molecular Weight:
268.8055
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Product Description
Catalog Number:
AG01BA8N
Chemical Name:
2-(4-methylpiperidin-4-yl)-1,3-benzothiazole hydrochloride
CAS Number:
1803604-60-5
Molecular Formula:
C13H17ClN2S
Molecular Weight:
268.8055
MDL Number:
MFCD28397560
IUPAC Name:
2-(4-methylpiperidin-4-yl)-1,3-benzothiazole;hydrochloride
InChI:
InChI=1S/C13H16N2S.ClH/c1-13(6-8-14-9-7-13)12-15-10-4-2-3-5-11(10)16-12;/h2-5,14H,6-9H2,1H3;1H
InChI Key:
DJIHPROZEAUQQU-UHFFFAOYSA-N
SMILES:
CC1(CCNCC1)c1nc2c(s1)cccc2.Cl
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
268.803g/mol
Monoisotopic Mass:
268.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties